Molecule structure of Sodium mannitol antimonate (CAS NO.6963-70-8) :
IUPAC Name: sodium 1-[2-(hydroxymethyl)-3,5-dioxa-4λ2-stibacyclopent-1-yl]propane-1,2,3-triol trihydrate
Molecular Weight: 378.95149 g/mol
Molecular Formula: C6H18NaO9Sb+
Boiling Point: 494.9 °C at 760 mmHg
Flash Point: 292.6 °C
Enthalpy of Vaporization: 87.81 kJ/mol
Vapour Pressure: 7.22E-12 mmHg at 25 °C
H-Bond Donor: 7
H-Bond Acceptor: 9
Rotatable Bond Count: 4
Exact Mass: 377.98867
MonoIsotopic Mass: 377.98867
Topological Polar Surface Area: 102
Heavy Atom Count: 17
Formal Charge: 1
Complexity: 159
Canonical SMILES: C(C1C(O[Sb]O1)C(C(CO)O)O)O.O.O.O.[Na+]
InChI: InChI=1S/C6H12O6.Na.3H2O.Sb/c7-1-3(9)5(11)6(12)4(10)2-8;;;;;/h3-9,11H,1-2H2;;3*1H2;/q-2;+1;;;;+2
InChIKey of Sodium mannitol antimonate (CAS NO.6963-70-8) : YKVQODUJUUENIC-UHFFFAOYSA-N
1. | ivn-mus LD50:5100 mg/kg | CLDND* Compilation of LD50 Values of New Drugs. 37 (S-7),(1988),5. |
Antimony and its compounds are on the Community Right-To-Know List.
Most antimony compounds are poisons by ingestion, inhalation, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of Sb and Na2O. See also ANTIMONY COMPOUNDS.
OSHA PEL: TWA 0.5 mg(Sb)/m3
ACGIH TLV: TWA 0.5 mg(Sb)/m3
NIOSH REL: (Antimony) TWA 0.5 mg(Sb)/m3
Sodium mannitol antimonate (CAS NO.6963-70-8) is also called NSC 15617 .
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